[Pw_forum] Improve convergence, slab and electric field.
Paolo Giannozzi
giannozz at democritos.it
Sat Aug 28 09:37:28 CEST 2010
On Aug 27, 2010, at 17:29 , joaquin peralta wrote:
> tefield = .true.
> dipfield = .true.
what about the calculation without external electric
fields? you should start from the charge and
wavefunctions calculated without electric fields
P.
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Paolo Giannozzi, Dept of Physics, University of Udine
via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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